Related references
Note: Only part of the references are listed.1,3-Dipolar Cycloadditions by a Unified Perspective Based on Conceptual and Thermodynamics Models of Chemical Reactivity
Cesar Barrales-Martinez et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2021)
Interacting Quantum Atoms Analysis of the Reaction Force: A Tool to Analyze Driving and Retarding Forces in Chemical Reactions
Cesar Barrales-Martinez et al.
CHEMPHYSCHEM (2021)
Theoretical Study of the Mechanism of Catalytic Enanteoselective N-H and O-H Insertion Reactions
Rocio Duran et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2020)
Real-Space Approach to the Reaction Force: Understanding the Origin of Synchronicity/Nonsynchronicity in Multibond Chemical Reactions
Diana Yepes et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2020)
Further understanding of the Ru-centered [2+2] cycloreversion/cycloaddition involved into the interconversion of ruthenacyclobutane using the Grubbs catalysts from a reaction force analysis
Katherine Paredes-Gil et al.
JOURNAL OF MOLECULAR MODELING (2019)
Effect of the exchange-correlation functional on the synchronicity/nonsynchronicity in bond formation in Diels-Alder reactions: a reaction force constant analysis
Diana Yepes et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2019)
Solvent effect on the degree of (a)synchronicity in polar Diels-Alder reactions from the perspective of the reaction force constant analysis
Diana Yepes et al.
JOURNAL OF MOLECULAR MODELING (2018)
Molecular hydrogen formation in the interstellar medium: the role of polycyclic aromatic hydrocarbons analysed by the reaction force and activation strain model
Cesar Barrales-Martinez et al.
MONTHLY NOTICES OF THE ROYAL ASTRONOMICAL SOCIETY (2018)
Beyond the classical thermodynamic contributions to hydrogen atom abstraction reactivity
Daniel Bim et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2018)
Analyzing Reaction Rates with the Distortion/Interaction-Activation Strain Model
F. Matthias Bickelhaupt et al.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2017)
Atomic decomposition of conceptual DFT descriptors: application to proton transfer reactions
Ricardo Inostroza-Rivera et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2015)
Driving and retarding forces in a chemical reaction
Peter Politzer et al.
JOURNAL OF MOLECULAR MODELING (2014)
Complementarity of reaction force and electron localization function analyses of asynchronicity in bond formation in Diels-Alder reactions
Diana Yepes et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2014)
Natural triple excitations in local coupled cluster calculations with pair natural orbitals
Christoph Riplinger et al.
JOURNAL OF CHEMICAL PHYSICS (2013)
Fine structure in the transition region: reaction force analyses of water-assisted proton transfers
Diana Yepes et al.
JOURNAL OF MOLECULAR MODELING (2013)
Perspectives on the reaction force constant
Peter Politzer et al.
JOURNAL OF MOLECULAR MODELING (2013)
The reaction force constant as an indicator of synchronicity/nonsynchronicity in [4+2] cycloaddition processes
Diana Yepes et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2013)
The reaction force constant: an indicator of the synchronicity in double proton transfer reactions
Diana Yepes et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2012)
The reaction force and the transition region of a reaction
Alejandro Toro-Labbe et al.
JOURNAL OF MOLECULAR MODELING (2009)
Reaction Force Analysis of Solvent Effects in the Addition of HCl to Propene
Jaroslav V. Burda et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2009)
Reaction force constant and projected force constants of vibrational modes along the path of an intramolecular proton transfer reaction
Pablo Jaque et al.
CHEMICAL PHYSICS LETTERS (2008)
Theory of 1,3-dipolar cycloadditions: Distortion/interaction and frontier molecular orbital models
Daniel H. Ess et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2008)
Distortion/Interaction energy control of 1,3-dipolar cycloaddition reactivity
Daniel H. Ess et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2007)
Reaction force decomposition of activation barriers to elucidate solvent effects
Jaroslav V. Burda et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2007)
Reaction force analysis of the effect of Mg(II) on the 1,3 intramolecular hydrogen transfer in thymine
Elizabeth Rincon et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2006)
The reaction force:: Three key points along an intrinsic reaction coordinate
P Politzer et al.
JOURNAL OF CHEMICAL SCIENCES (2005)
Femtochemistry: Atomic-scale dynamics of the chemical bond
AH Zewail
JOURNAL OF PHYSICAL CHEMISTRY A (2000)
Share Paper
